COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL383519
Chemical Name: 4-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]-2-bromophenylnaphthalene-1-carboxylate
Smiles: N#C/C(=C\c1ccc(c(c1)Br)OC(=O)c1cccc2c1cccc2)/c1nc2c(s1)cccc2

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Molecular Weight: 511.4
Empirical Formula: C27H15BrN2O2S

Physical State: Dry powder
Available Amount: 140 mg

Lipinsky:
logP: 8.241
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 91
Number of rings: 5

     

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